SCHEMBL20121987

SCHEMBL20121987

CCCCCNC(=O)CC(C)(C)C

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CASP2 P42575 1/20 0.59
NAAA Q02083 1/20 0.55
EPHX1 P07099 8/20 0.54
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
FAAH O00519 2/20 0.50
ZDHHC20 Q5W0Z9 1/20 0.46
ZDHHC2 Q9UIJ5 1/20 0.46
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL20121986 0.98 CASP2 (0.62) CASP2NAAAEPHX1MEN1KMT2A
SCHEMBL20417361 0.98 CASP2 (0.62) CASP2NAAAEPHX1MEN1KMT2A
SCHEMBL20134457 0.98 CASP2 (0.62) CASP2NAAAEPHX1MEN1KMT2A
SCHEMBL23567476 0.98 CASP2 (0.62) CASP2NAAAEPHX1MEN1KMT2A
SCHEMBL4308618 0.94 CASP2 (0.50) CASP2NAAAEPHX1MEN1KMT2A
SCHEMBL23518488 0.89 MEN1 (0.52) CASP2NAAAEPHX1MEN1KMT2A
SCHEMBL9433161 0.86 CASP2 (0.57) CASP2NAAAEPHX1MEN1KMT2A
SCHEMBL9433171 0.86 CASP2 (0.57) CASP2NAAAEPHX1MEN1KMT2A
SCHEMBL2730881 0.85 MCL1 (0.48) CASP2EPHX1MEN1KMT2A
SCHEMBL26504638 0.84 MEN1 (0.48) CASP2NAAAEPHX1MEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230338551-A1 DEGRADATION OF BRUTON'S TYROSINE KINASE (BTK) BY CONJUGATION OF BTK INHIBITORS WITH E3 LIGASE LIGAND AND METHODS OF USE DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-10-26 US disclosed
US-11730818-B2 Degradation of Bruton's tyrosine kinase (BTK) by conjugation of BTK inhibitors with E3 ligase ligand and methods of use DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-08-22 US disclosed
US-11712458-B2 Degradation of Bruton's tyrosine kinase (BTK) by conjugation of BTK inhibitors with E3 ligase ligand and methods of use DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-08-01 US disclosed
US-9963447-B2 Substituted 4-azaindoles and their use as GluN2B receptor modulators JANSSEN PHARMACEUTICA NV (BE) 2018-05-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11712458-B2 Degradation of Bruton's tyrosine kinase (BTK) by conjugation of BTK inhibitors with E3 ligase ligand and methods of use BTK, CBL, SYK CASP2 1965/4885NAAA 4427/4885EPHX1 2162/4885
US-11730818-B2 Degradation of Bruton's tyrosine kinase (BTK) by conjugation of BTK inhibitors with E3 ligase ligand and methods of use BTK, CBL, SYK CASP2 2104/4885NAAA 4462/4885EPHX1 1786/4885
US-20230338551-A1 DEGRADATION OF BRUTON'S TYROSINE KINASE (BTK) BY CONJUGATION OF BTK INHIBITORS WITH E3 LIGASE LIGAND AND METHODS OF USE BTK, CBL, SYK CASP2 2104/4885NAAA 4462/4885EPHX1 1786/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.